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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-117666
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Be', 'Tl', 'Cl']
  • Chemical System: Be-Cl-Tl
  • Density: 4.813642158545769
  • Atomic Density: 0.034947085580836264
  • Unit Cell Volume: 85.8440682574427
  • Molar Volume: 17.232168748578932
  • Full Formula: Be1 Tl1 Cl1
  • Reduced Formula: BeTlCl
  • Formula Anonymous: ABC
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m